[2-(5-ethylthiophen-2-yl)-2-oxidanylidene-ethyl] 1-[(2-chlorophenyl)methyl]-3,5-dimethyl-pyrazole-4-carboxylate

Systemtic Name: [2-(5-ethylthiophen-2-yl)-2-oxidanylidene-ethyl] 1-[(2-chlorophenyl)methyl]-3,5-dimethyl-pyrazole-4-carboxylate Openeye Name: [2-(5-ethyl-2-thienyl)-2-oxo-ethyl] 1-[(2-chlorophenyl)methyl]-3,5-dimethyl-pyrazole-4-carboxylate CAS Name: 1-[(2-chlorophenyl)methyl]-3,5-dimethyl-4-pyrazolecarboxylic acid [2-(5-ethyl-2-thiophenyl)-2-oxoethyl] ester IUPAC Name: [2-(5-ethylthiophen-2-yl)-2-oxoethyl] 1-[(2-chlorophenyl)methyl]-3,5-dimethylpyrazole-4-carboxylate Traditional Name: 1-(2-chlorobenzyl)-3,5-dimethyl-pyrazole-4-carboxylic acid [2-(5-ethyl-2-thienyl)-2-keto-ethyl] ester Formula: C21H21ClN2O3S MolecularWeight: 416.92104

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(S1)C(=O)COC(=O)C2=C(N(N=C2C)CC3=CC=CC=C3Cl)C

Isomeric SMILES

CCC1=CC=C(S1)C(=O)COC(=O)C2=C(N(N=C2C)CC3=CC=CC=C3Cl)C

InChI

InChI=1S/C21H21ClN2O3S/c1-4-16-9-10-19(28-16)18(25)12-27-21(26)20-13(2)23-24(14(20)3)11-15-7-5-6-8-17(15)22/h5-10H,4,11-12H2,1-3H3